Glycoside
GD067338
Name:
NoneFormula:
C15H22O8N2Smiles:
CO/N=C(\C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccco1Aglycone:
CON=C(C(=O)NCCO)c1ccco1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 358.35 | Num_heavy_atoms: | 25 |
| TPSA: | 142.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD32127
Formula: C9H12O4N2
Smiles:
CON=C(C(=O)NCCO)c1ccco1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 212.2 | Num_heavy_atoms: | 15 |
| TPSA: | 84.06 | NumAromaticRings: | 1 |
